3,5-dimethyl-4-[[4-(2-methylcyclohexyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[[4-(2-methylcyclohexyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[[4-(2-methylcyclohexyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]isoxazole CAS Name: 3,5-dimethyl-4-[[[4-(2-methylcyclohexyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[[4-(2-methylcyclohexyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[[[4-(2-methylcyclohexyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]isoxazole Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2C(=NN=C2SCC3=C(ON=C3C)C)C4=CN=CC=C4

Isomeric SMILES

CC1CCCCC1N2C(=NN=C2SCC3=C(ON=C3C)C)C4=CN=CC=C4

InChI

InChI=1S/C20H25N5OS/c1-13-7-4-5-9-18(13)25-19(16-8-6-10-21-11-16)22-23-20(25)27-12-17-14(2)24-26-15(17)3/h6,8,10-11,13,18H,4-5,7,9,12H2,1-3H3